Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | S1PR1 | P21453 | 13/20 | 0.62 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | TAOK1 | Q7L7X3 | 1/20 | 0.46 |
| ▸ | TAOK3 | Q9H2K8 | 1/20 | 0.46 |
| ▸ | LTA4H | P09960 | 1/20 | 0.44 |
| ▸ | CTSS | P25774 | 1/20 | 0.43 |
| ▸ | NPY5R | Q15761 | 1/20 | 0.43 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1373995 | 0.87 | S1PR1 (0.68) | S1PR1TAOK1TAOK3LTA4H | |
| SCHEMBL2365173 | 0.85 | S1PR1 (0.74) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 | |
| SCHEMBL13392751 | 0.85 | S1PR1 (0.73) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 | |
| SCHEMBL12044808 | 0.85 | S1PR1 (0.73) | S1PR1SMN1; SMN2RAB9ATAOK1TAOK3 | |
| SCHEMBL1374371 | 0.83 | S1PR1 (0.68) | S1PR1TAOK1TAOK3LTA4H | |
| SCHEMBL1373528 | 0.83 | S1PR1 (0.68) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 | |
| SCHEMBL1376155 | 0.82 | S1PR1 (0.73) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 | |
| SCHEMBL1373265 | 0.82 | S1PR1 (0.67) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 | |
| SCHEMBL12044883 | 0.82 | S1PR1 (0.67) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 | |
| SCHEMBL1372544 | 0.82 | S1PR1 (0.67) | S1PR1SMN1; SMN2NPC1RAB9ATAOK1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2346821-A1 | SPHINGOSINE-1-PHOSPHATE RECEPTOR ANTAGONISTS | Exelixis, Inc. (US) | 2011-07-27 | — | — | EP | disclosed |
| WO-2010045580-A1 | SPHINGOSINE-1-PHOSPHATE RECEPTOR ANTAGONISTS | EXELIXIS, INC. (US) | 2010-04-22 | — | — | WO | disclosed |